Glycoside
...
GD135445

Name:
None

Formula:
C38H37O12N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(OC3(O)OC(CO)C(O)C(O)C3O)c(O)cc2C2C(Cc3ccccc3)C=CC21C(=O)O

Aglycone:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(Cc3ccccc3)C=CC21C(=O)O

Sugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 8 FractionCSP3: 0.32
AlogP: 1.02 Num_rotatable_bonds: 10
MolWt: 727.72 Num_heavy_atoms: 53
TPSA: 242.4 NumAromaticRings: 3

Unique Aglycone
AD49048
Formula: C32H27O6N3

Smiles:
O=C(C=Cc1ccc(O)c(CC2=NCN=C2)c1)N1c2cc(O)c(O)cc2C2C(Cc3ccccc3)C=CC21C(=O)O
HBA: 9 RingCount: 6
HBD: 4 FractionCSP3: 0.19
AlogP: 4.22 Num_rotatable_bonds: 7
MolWt: 549.58 Num_heavy_atoms: 41
TPSA: 143.02 NumAromaticRings: 3

Sugarmoiety
SD00999

OCC1OC(O)(O)C(O)C(O)C1O